3-(1-methylindol-3-yl)-2-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]-3H-isoindol-1-one

Systemtic Name: 3-(1-methylindol-3-yl)-2-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]-3H-isoindol-1-one Openeye Name: 3-(1-methylindol-3-yl)-2-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]isoindolin-1-one CAS Name: 3-(1-methyl-3-indolyl)-2-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-3H-isoindol-1-one IUPAC Name: 3-(1-methylindol-3-yl)-2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-3H-isoindol-1-one Traditional Name: 2-[2-keto-2-(4-methylpiperazino)ethyl]-3-(1-methylindol-3-yl)isoindolin-1-one Formula: C24H26N4O2 MolecularWeight: 402.48884

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)CN2C(C3=CC=CC=C3C2=O)C4=CN(C5=CC=CC=C54)C

Isomeric SMILES

CN1CCN(CC1)C(=O)CN2C(C3=CC=CC=C3C2=O)C4=CN(C5=CC=CC=C54)C

InChI

InChI=1S/C24H26N4O2/c1-25-11-13-27(14-12-25)22(29)16-28-23(18-8-3-4-9-19(18)24(28)30)20-15-26(2)21-10-6-5-7-17(20)21/h3-10,15,23H,11-14,16H2,1-2H3